1,2,4-Tribromobenzene - CAS 615-54-3
Catalog: |
BB031177 |
Product Name: |
1,2,4-Tribromobenzene |
CAS: |
615-54-3 |
Synonyms: |
1,2,4-tribromobenzene |
IUPAC Name: | 1,2,4-tribromobenzene |
Description: | 1,2,4-Tribromobenzene (CAS# 615-54-3) is a compound commonly used in organic synthesis reactions. 1,2,4-Tribromobenzene is hepatotoxic to rats, and is also toxic to humans. |
Molecular Weight: | 314.80 |
Molecular Formula: | C6H3Br3 |
Canonical SMILES: | C1=CC(=C(C=C1Br)Br)Br |
InChI: | InChI=1S/C6H3Br3/c7-4-1-2-5(8)6(9)3-4/h1-3H |
InChI Key: | FWAJPSIPOULHHH-UHFFFAOYSA-N |
Boiling Point: | 277.3 °C at 760 mmHg |
Density: | 2.281 g/cm3 |
Appearance: | White crystalline powder |
MDL: | MFCD00000062 |
LogP: | 3.97410 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021328165-A1 | Emissive layer with layered quantum dots with different ligands for qleds | 20200421 |
CN-113161496-A | Oxygen scavenging nanoparticles for air treatment of quantum dot light emitting diodes | 20200106 |
US-10985336-B1 | Oxygen scavenging nanoparticles for air-processed quantum dot light emitting diodes | 20200106 |
US-11024820-B2 | Photo-patterned emissive layer containing passivated quantum dots, arrangement of light-emitting devices including same, and method of making same | 20190808 |
US-2021043862-A1 | Photo-patterned emissive layer containing passivated quantum dots, arrangement of light-emitting devices including same, and method of making same | 20190808 |
PMID | Publication Date | Title | Journal |
22800291 | 20120821 | Growth of Dehalococcoides mccartyi strain CBDB1 by reductive dehalogenation of brominated benzenes to benzene | Environmental science & technology |
22476434 | 20120601 | Subchronic hepatotoxicity evaluation of 1,2,4-tribromobenzene in Sprague-Dawley rats | International journal of toxicology |
15268124 | 20040615 | Calculation of the A term of magnetic circular dichroism based on time dependent-density functional theory I. Formulation and implementation | The Journal of chemical physics |
9456081 | 19980101 | Hepatotoxicity of brominated benzenes: relationship between chemical structure and hepatotoxic effects in acute intoxication of mice | Archives of toxicology |
437040 | 19790415 | Brominated benzene induction of hepatic porphyria | Experientia |
Complexity: | 94.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 313.77644 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 311.77849 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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